Project name: 83f08de2c9781c3

Chain sequence(s)	A: KLVFFAE; C: KLVFFAE; B: KLVFFAE; E: KLVFFAE; D: KLVFFAE; G: KLVFFAE; F: KLVFFAE; I: KLVFFAE; H: KLVFFAE; K: KLVFFAE; J: KLVFFAE; M: KLVFFAE; L: KLVFFAE; O: KLVFFAE; N: KLVFFAE; Q: KLVFFAE; P: KLVFFAE; S: KLVFFAE; R: KLVFFAE; T: KLVFFAE
Selected Chain(s)	A,C,B,E,D,G,F,I,H,K,J,M,L,O,N,Q,P,S,R,T
Distance of aggregation	10 Å
FoldX usage	Yes
Dynamic mode	No
Automated mutations	No

Simulation log

[INFO]       Logger:   Verbosity set to: 2 - [INFO]                                                (00:00:01)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:01)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with all chain(s) selected           (00:00:01)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:01)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:06:06)
[INFO]       Main:     Simulation completed successfully.                                          (00:06:10)

• Minimal score value: -3.1942
• Maximal score value: 3.872
• Average score: -0.3115
• Total score value: -43.6125

The table below lists A3D score for protein residues. Residues with A3D score > 0.0000 are marked by yellow rows.

residue index	residue name	chain	Aggrescan3D score	mutation
1	K	A	-2.7261
2	L	A	-1.2008
3	V	A	-0.0808
4	F	A	0.5365
5	F	A	0.0000
6	A	A	-1.5343
7	E	A	-2.6410
1	K	B	-2.2495
2	L	B	0.0000
3	V	B	0.0000
4	F	B	0.0000
5	F	B	0.0000
6	A	B	0.0000
7	E	B	-2.7384
1	K	C	-2.2181
2	L	C	0.0000
3	V	C	0.0000
4	F	C	0.0000
5	F	C	0.0000
6	A	C	0.0000
7	E	C	-2.9646
1	K	D	-1.5559
2	L	D	1.0470
3	V	D	2.2676
4	F	D	3.0083
5	F	D	1.5708
6	A	D	-0.3029
7	E	D	-2.2931
1	K	E	-2.5699
2	L	E	-0.7940
3	V	E	0.0000
4	F	E	1.8280
5	F	E	0.0000
6	A	E	-0.6258
7	E	E	-2.3522
1	K	F	-2.0998
2	L	F	0.0818
3	V	F	2.1450
4	F	F	2.5205
5	F	F	2.1557
6	A	F	-0.3703
7	E	F	-2.1967
1	K	G	-2.4506
2	L	G	0.0000
3	V	G	1.3762
4	F	G	0.0000
5	F	G	1.0278
6	A	G	0.0000
7	E	G	-2.6970
1	K	H	-2.9497
2	L	H	0.0000
3	V	H	1.0202
4	F	H	0.0000
5	F	H	0.6492
6	A	H	0.0000
7	E	H	-3.0777
1	K	I	-2.7988
2	L	I	0.0000
3	V	I	0.7223
4	F	I	0.0000
5	F	I	0.5150
6	A	I	0.0000
7	E	I	-2.9466
1	K	J	-3.0715
2	L	J	0.0000
3	V	J	0.8524
4	F	J	0.0000
5	F	J	0.7195
6	A	J	-1.2612
7	E	J	-3.1425
1	K	K	-2.7096
2	L	K	-0.5855
3	V	K	1.0296
4	F	K	1.6839
5	F	K	0.6921
6	A	K	-1.0822
7	E	K	-3.0926
1	K	L	-3.0030
2	L	L	-0.9417
3	V	L	0.8693
4	F	L	1.7388
5	F	L	0.6890
6	A	L	-1.0549
7	E	L	-2.9391
1	K	M	-2.8180
2	L	M	-0.5085
3	V	M	0.9489
4	F	M	1.8522
5	F	M	0.6874
6	A	M	-0.9988
7	E	M	-3.0711
1	K	N	-2.5921
2	L	N	-0.2053
3	V	N	1.6579
4	F	N	3.0052
5	F	N	1.7280
6	A	N	-0.0314
7	E	N	-2.4361
1	K	O	-1.4229
2	L	O	1.4893
3	V	O	2.8953
4	F	O	3.8720
5	F	O	2.0720
6	A	O	-0.0162
7	E	O	-2.1587
1	K	P	-1.5268
2	L	P	1.0479
3	V	P	1.9497
4	F	P	3.2012
5	F	P	1.1934
6	A	P	-0.3529
7	E	P	-2.2817
1	K	Q	-2.8395
2	L	Q	-0.4698
3	V	Q	0.9312
4	F	Q	2.4022
5	F	Q	1.2575
6	A	Q	-0.1431
7	E	Q	-2.3293
1	K	R	-2.3720
2	L	R	-0.2366
3	V	R	0.0000
4	F	R	1.7094
5	F	R	0.0000
6	A	R	-1.0499
7	E	R	-3.1942
1	K	S	-2.5589
2	L	S	-0.5515
3	V	S	0.0000
4	F	S	2.1219
5	F	S	0.0000
6	A	S	-0.3877
7	E	S	-2.4728
1	K	T	-1.7103
2	L	T	0.9496
3	V	T	1.8021
4	F	T	2.7860
5	F	T	0.9689
6	A	T	-0.4891
7	E	T	-2.3446